Search results for "fractal dimension."
showing 10 items of 75 documents
Characterizing cavities in model inclusion molecules: a comparative study
1998
We have selected fullerene-60 and -70 cavities as model systems in order to test several methods for characterizing inclusion molecules. The methods are based on different technical foundations such as a square and triangular tessellation of the molecule taken as a unitary sphere, spherical tessellation of the molecular surface, numerical integration of the atomic volumes and surfaces, triangular tessellation of the molecular surface, and a cubic lattice approach to a molecular space. Accurate measures of the molecular volume and surface area have been performed with the pseudo-random Monte Carlo (MCVS) and uniform Monte Carlo (UMCVS) methods. These calculations serve as a reference for the…
The Combined Ultra-Small- and Small-Angle Neutron Scattering (USANS/SANS) Technique for Earth Sciences
2009
The extension of the well-known Small-Angle Neutron Scattering (SANS) technique to Ultra-Small Angles (USANS) provides a unique tool for studying hierarchical structures ranging in size from nanometers to micrometers. Hierarchical structures are common for many natural and man-made materials, which show multi-level morphology (atoms–molecules–aggregates–agglomerates), in other words, are made up of structural units encompassing the atomic, molecular, micro- and macroscopic length scales. Combining USANS and SANS data can provide complete structural information for complicated polydisperse systems, allowing the determination of their complex morphology and hence has been successfully applied…
Molecular Classification of Pesticides Including Persistent Organic Pollutants, Phenylurea and Sulphonylurea Herbicides
2014
Pesticide residues in wine were analyzed by liquid chromatography–tandem mass spectrometry. Retentions are modelled by structure–property relationships. Bioplastic evolution is an evolutionary perspective conjugating effect of acquired characters and evolutionary indeterminacy–morphological determination–natural selection principles; its application to design co-ordination index barely improves correlations. Fractal dimensions and partition coefficient differentiate pesticides. Classification algorithms are based on information entropy and its production. Pesticides allow a structural classification by nonplanarity, and number of O, S, N and Cl atoms and cycles; different behaviours depend …
Topological effects in ring polymers. II. Influence of persistence length
1999
The interplay of topological constraints and persistence length of ring polymers in their own melt is investigated by means of dynamical Monte Carlo simulations of a three dimensional lattice model. We ask if the results are consistent with an asymptotically regime where the rings behave like (compact) {\em lattice animals} in a self-consistent network of topological constraints imposed by neighbouring rings. Tuning the persistence length provides an efficient route to increase the ring overlap required for this mean-field picture to hold: The {\em effective} Flory exponent for the ring size decreases down to $\nu \stackrel{<}{\sim} 1/3$ with increasing persistence length. Evidence is provi…
The multifractal character of the electronic states in disordered two-dimensional systems
1995
The nature of electronic states in disordered two-dimensional (2D) systems is investigated. With this aim, we present our calculations of both density of states and d.c. conductivity for square lattices modelling the Anderson Hamiltonian with on-site energies randomly chosen from a box distribution of width W. For weak disorder (W), the eigenfunctions calculated by means of the Lanczos diagonalization algorithm display spatial fluctuations reflecting their (multi)fractal behaviour. For increasing disorder the observed increase of the curdling of the wavefunction reflects its stronger localization. However, as a function of energy, the eigenstates at energy mod E mod /V approximately=1.5 are…
Fractal Aspects of Galaxy Clustering
2008
In the past decade, the mathematical concept of fractal has exerted a great influence in a large variety of scientific disciplines. It is very common to find recent papers on the application of fractals to different fields in Physics, Chemistry, Biology, etc. The success of the fractal geometry in the description of many systems is due to the fact that deep insights into very simple objects show how fractal measures are more natural for their study.
Multifractal wave functions at the Anderson transition.
1991
Electronic wave functions in disordered systems are studied within the Anderson model of localization. At the critical disorder in 3D we diagonalize very large (103 823\ifmmode\times\else\texttimes\fi{}103 823) secular matrices by means of the Lanczos algorithm. On all length scales the obtained strong spatial fluctuations of the amplitude of the eigenstates display a multifractal character, reflected in the set of generalized fractal dimensions and the singularity spectrum of the fractal measure. An analysis of 1D systems shows multifractality too, in contrast to previous claims.
Electronic States in Mesoscopic Systems
1992
Abstract Electronic states in disordered systems are studied within the Anderson model of localization. By means of the Green's function technique we derive the transmission coefficient for electronic states through mesoscopic samples. The transmission coefficient is shown to be not self-averaging due to strong spatial fluctuations of the amplitude of the eigenstates, which are obtained by direct diagonalization of the respective secular matrices. The wave functions display a multifractal behaviour, characterized by the set of generalized fractal dimensions and the singularity spectrum of the fractal measure.
Axial behaviour of Cantor ring diffractals
2003
Cantor ring diffractals describe rotationally symmetric pupils constructed from a one-dimensional polyadic Cantor set. The influence on the axial irradiance of several fractal descriptors of such pupils, including fractal dimension, number of gaps and lacunarity, are investigated. It is shown that, contrary to their transversal response, the axial behaviour of these pupils does not resemble the fractal structure of the aperture. The sensitivity of such pupils to the spherical aberration is also analysed.
Fractals and multifractals in the description of the cosmic structure
1990
Abstract The concepts of fractals and multifractals are applied to describe the large scale galaxy distribution. It is shown how the Universe fits the fractal geometry on small scales (several Mpc), but that there exists some cut-off where the scale invariance is broken. Even in the scaling region the cosmic structure is not a simple fractal, and the task is to introduce more complex and complete clustering descriptors. At this stage, the concept of multifractals appears to be more efficient to describe the texture of the Universe.